dizinc sulfidoformate

C2O4S2Zn2 — CID 21464809

IUPACdizinc sulfidoformate
SMILESO=C([O-])[S-].O=C([O-])[S-].[Zn+2].[Zn+2]
InChIInChI=1S/2CH2O2S.2Zn/c2*2-1(3)4;;/h2*4H,(H,2,3);;/q;;2*+2/p-4
InChIKeyXEROAVHLOSJWSS-UHFFFAOYSA-J
MW282.93 g/mol
LogP-2.25
Rot. Bonds

About dizinc sulfidoformate

dizinc sulfidoformate (PubChem CID 21464809) has the molecular formula C2O4S2Zn2 and a molecular weight of 282.93 g/mol. Its IUPAC name is dizinc sulfidoformate.

Molecular Properties

Compound Namedizinc sulfidoformate
PubChem CID21464809
Molecular FormulaC2O4S2Zn2
Molecular Weight282.93 g/mol
Exact Mass279.78
IUPAC Namedizinc sulfidoformate
SMILESO=C([O-])[S-].O=C([O-])[S-].[Zn+2].[Zn+2]
InChIInChI=1S/2CH2O2S.2Zn/c2*2-1(3)4;;/h2*4H,(H,2,3);;/q;;2*+2/p-4
InChIKeyXEROAVHLOSJWSS-UHFFFAOYSA-J
XLogP-2.25
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.93
LogP ≤ 5-2.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Related Compounds

dilithium;sulfidoformate
CID 22336321
dicopper sulfidoformate
CID 173380893
bismuth;zinc;carbonate
CID 18938595
zinc;azane;carbonate
CID 14029939
aluminum;zinc;carbonate
CID 162187008
trialuminum;trizinc;pentacarbonate;pentahydroxide
CID 173493328
dipotassium;oxocopper;carbonate
CID 172770959
zinc;zinc;carbonate;dihydrate
CID 11310663
plutonium dicarbonate
CID 22099017
bis(rhodium(3+));tricarbonate
CID 71471414
hexadecasodium;octacarbonate
CID 141056250
bis(gold(3+));tricarbonate
CID 56847861

Frequently Asked Questions

What is the IUPAC name of dizinc sulfidoformate?
The IUPAC name of dizinc sulfidoformate (CID 21464809) is dizinc sulfidoformate.
What is the SMILES notation for dizinc sulfidoformate?
The canonical SMILES for dizinc sulfidoformate is O=C([O-])[S-].O=C([O-])[S-].[Zn+2].[Zn+2].
What is the InChIKey of dizinc sulfidoformate?
The InChIKey is XEROAVHLOSJWSS-UHFFFAOYSA-J. The full InChI is InChI=1S/2CH2O2S.2Zn/c2*2-1(3)4;;/h2*4H,(H,2,3);;/q;;2*+2/p-4.
What are the key properties of dizinc sulfidoformate?
dizinc sulfidoformate has a molecular weight of 282.93 g/mol, XLogP of -2.25, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dizinc sulfidoformate is sourced from PubChem (CID 21464809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).